Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "e4422b8d2ad81538ff49a8febeabe7bc",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 122.916,
"b": 61.552,
"c": 79.726,
"alpha": 90.00,
"beta": 117.52,
"gamma": 90.00
},
"wavelengths": [0.97853],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [70.70,2.66],
"number_observations": 74613,
"number_observations_unique": 15111,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.169
},
{
"type": "R(meas)",
"value": 0.188
},
{
"type": "R(pim)",
"value": 0.081
},
{
"type": "I/SigI",
"value": 7.5
},
{
"type": "Completeness",
"value": 98.4
},
{
"type": "Redundancy",
"value": 4.9
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
"refln_shells": [
{
"resolution_limits": [2.80,2.66],
"number_observations": 10732,
"number_observations_unique": 2183,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.792
},
{
"type": "R(meas)",
"value": 0.883
},
{
"type": "R(pim)",
"value": 0.383
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Redundancy",
"value": 4.9
},
{
"type": "CC(1/2)",
"value": 0.752
}
]
}
]
}